methyl (3R,3aS,6aS)-6a-methyl-2-phenyl-3a,4,5,6-tetrahydro-3H-cyclopenta[c]pyrazol-2-ium-3-carboxylate

Systemtic Name: methyl (3R,3aS,6aS)-6a-methyl-2-phenyl-3a,4,5,6-tetrahydro-3H-cyclopenta[c]pyrazol-2-ium-3-carboxylate Openeye Name: methyl (3R,3aS,6aS)-6a-methyl-2-phenyl-3a,4,5,6-tetrahydro-3H-cyclopenta[c]pyrazol-2-ium-3-carboxylate CAS Name: (3R,3aS,6aS)-6a-methyl-2-phenyl-3a,4,5,6-tetrahydro-3H-cyclopenta[c]pyrazol-2-ium-3-carboxylic acid methyl ester IUPAC Name: methyl (3R,3aS,6aS)-6a-methyl-2-phenyl-3a,4,5,6-tetrahydro-3H-cyclopenta[c]pyrazol-2-ium-3-carboxylate Traditional Name: (3R,3aS,6aS)-6a-methyl-2-phenyl-3a,4,5,6-tetrahydro-3H-cyclopenta[c]pyrazol-2-ium-3-carboxylic acid methyl ester Formula: C15H19N2O2+ MolecularWeight: 259.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC1C([N+](=N2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

C[C@]12CCC[C@H]1[C@@H]([N+](=N2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C15H19N2O2/c1-15-10-6-9-12(15)13(14(18)19-2)17(16-15)11-7-4-3-5-8-11/h3-5,7-8,12-13H,6,9-10H2,1-2H3/q+1/t12-,13+,15-/m0/s1